U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C15H19Cl2N3O
Molecular Weight 328.237
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BERSIPOROCIN

SMILES

O[C@H]1CCCN[C@@H]1CCCN2C=NC3=C2C=CC(Cl)=C3Cl

InChI

InChIKey=VXCNMWNXDDMFSX-YPMHNXCESA-N
InChI=1S/C15H19Cl2N3O/c16-10-5-6-12-15(14(10)17)19-9-20(12)8-2-3-11-13(21)4-1-7-18-11/h5-6,9,11,13,18,21H,1-4,7-8H2/t11-,13+/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H19Cl2N3O
Molecular Weight 328.237
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 16:48:08 GMT 2023
Edited
by admin
on Sat Dec 16 16:48:08 GMT 2023
Record UNII
TTU6QSK1G5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BERSIPOROCIN
INN  
Official Name English
3-PIPERIDINOL, 2-(3-(4,5-DICHLORO-1H-BENZIMIDAZOL-1-YL)PROPYL)-, (2R,3S)
Common Name English
DWN12088
Code English
(2R,3S)-2-(3-(4,5-DICHLORO-1H-BENZO(D)IMIDAZOL-1-YL)PROPYL)PIPERIDIN-3-OL
Common Name English
DWN-12088
Code English
bersiporocin [INN]
Common Name English
Code System Code Type Description
INN
11700
Created by admin on Sat Dec 16 16:48:08 GMT 2023 , Edited by admin on Sat Dec 16 16:48:08 GMT 2023
PRIMARY
SMS_ID
300000042075
Created by admin on Sat Dec 16 16:48:08 GMT 2023 , Edited by admin on Sat Dec 16 16:48:08 GMT 2023
PRIMARY
FDA UNII
TTU6QSK1G5
Created by admin on Sat Dec 16 16:48:08 GMT 2023 , Edited by admin on Sat Dec 16 16:48:08 GMT 2023
PRIMARY
CAS
2241808-52-4
Created by admin on Sat Dec 16 16:48:08 GMT 2023 , Edited by admin on Sat Dec 16 16:48:08 GMT 2023
PRIMARY
NCI_THESAURUS
C188631
Created by admin on Sat Dec 16 16:48:08 GMT 2023 , Edited by admin on Sat Dec 16 16:48:08 GMT 2023
PRIMARY
PUBCHEM
142411678
Created by admin on Sat Dec 16 16:48:08 GMT 2023 , Edited by admin on Sat Dec 16 16:48:08 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
TARGET -> INHIBITOR
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ACTIVE MOIETY